2-(4-bromanyl-2,3,5-trimethyl-phenoxy)-1-[4-(4-methoxyphenyl)piperazin-1-yl]ethanone

Systemtic Name: 2-(4-bromanyl-2,3,5-trimethyl-phenoxy)-1-[4-(4-methoxyphenyl)piperazin-1-yl]ethanone Openeye Name: 2-(4-bromo-2,3,5-trimethyl-phenoxy)-1-[4-(4-methoxyphenyl)piperazin-1-yl]ethanone CAS Name: 2-(4-bromo-2,3,5-trimethylphenoxy)-1-[4-(4-methoxyphenyl)-1-piperazinyl]ethanone IUPAC Name: 2-(4-bromo-2,3,5-trimethylphenoxy)-1-[4-(4-methoxyphenyl)piperazin-1-yl]ethanone Traditional Name: 2-(4-bromo-2,3,5-trimethyl-phenoxy)-1-[4-(4-methoxyphenyl)piperazino]ethanone Formula: C22H27BrN2O3 MolecularWeight: 447.36538

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1Br)C)C)OCC(=O)N2CCN(CC2)C3=CC=C(C=C3)OC

Isomeric SMILES

CC1=CC(=C(C(=C1Br)C)C)OCC(=O)N2CCN(CC2)C3=CC=C(C=C3)OC

InChI

InChI=1S/C22H27BrN2O3/c1-15-13-20(16(2)17(3)22(15)23)28-14-21(26)25-11-9-24(10-12-25)18-5-7-19(27-4)8-6-18/h5-8,13H,9-12,14H2,1-4H3